2-(3,5-dichlorophenyl)ethanamine

C8H9Cl2N — CID 15670830

IUPAC2-(3,5-dichlorophenyl)ethanamine
SMILESNCCc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C8H9Cl2N/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5H,1-2,11H2
InChIKeyHEEUTZAJXBKBEJ-UHFFFAOYSA-N
MW190.07 g/mol
LogP2.49
Rot. Bonds2

About 2-(3,5-dichlorophenyl)ethanamine

2-(3,5-dichlorophenyl)ethanamine (PubChem CID 15670830) has the molecular formula C8H9Cl2N and a molecular weight of 190.07 g/mol. Its IUPAC name is 2-(3,5-dichlorophenyl)ethanamine.

Molecular Properties

Compound Name2-(3,5-dichlorophenyl)ethanamine
PubChem CID15670830
Molecular FormulaC8H9Cl2N
Molecular Weight190.07 g/mol
Exact Mass189.01
IUPAC Name2-(3,5-dichlorophenyl)ethanamine
SMILESNCCc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C8H9Cl2N/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5H,1-2,11H2
InChIKeyHEEUTZAJXBKBEJ-UHFFFAOYSA-N
XLogP2.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.07
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

p-Chloroamphetamine
CID 3127
Benzenemethanamine, 3,5-dichloro-
CID 457602
Benzenemethanamine, 3-chloro-
CID 77802
p-Chloroamphetamine hydrochloride
CID 107161
2,4-Dichlorophenethylamine
CID 142938
3,4-Dichlorophenethylamine
CID 217958
Benzenemethanamine, 2,6-dichloro-
CID 485432
2-(2-Chlorophenyl)ethylamine
CID 83117
3-Chlorophenethylamine
CID 139381
2,6-Dichlorophenethylamine
CID 2734101
2-(4-Chlorophenyl)ethylamine
CID 67430
1-(2,4-Dichlorophenyl)Ethylamine
CID 2771858

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dichlorophenyl)ethanamine?
The IUPAC name of 2-(3,5-dichlorophenyl)ethanamine (CID 15670830) is 2-(3,5-dichlorophenyl)ethanamine.
What is the SMILES notation for 2-(3,5-dichlorophenyl)ethanamine?
The canonical SMILES for 2-(3,5-dichlorophenyl)ethanamine is NCCc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 2-(3,5-dichlorophenyl)ethanamine?
The InChIKey is HEEUTZAJXBKBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9Cl2N/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5H,1-2,11H2.
What are the key properties of 2-(3,5-dichlorophenyl)ethanamine?
2-(3,5-dichlorophenyl)ethanamine has a molecular weight of 190.07 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dichlorophenyl)ethanamine is sourced from PubChem (CID 15670830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).